Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | RGS12 | O14924 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1052126 | 0.82 | PARP1 (0.56) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL28108469 | 0.79 | PARP1 (0.51) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL3257586 | 0.78 | PARP1 (0.54) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL8205632 | 0.75 | PARP1 (0.54) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL1756367 | 0.75 | PARP1 (0.63) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL789453 | 0.74 | PARP1 (0.61) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL29089233 | 0.73 | PARP1 (0.66) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL16116423 | 0.73 | PARP1 (0.59) | PARP1NPSR1GAARXFP1KDM4E | |
| SCHEMBL30730457 | 0.73 | PARP1 (0.59) | PARP1NPSR1ALDH1A1KMT2AMEN1 | |
| SCHEMBL28206411 | 0.73 | PARP1 (0.59) | PARP1NPSR1ALDH1A1KMT2AMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107513083-B | Preparation method and application of glycosyl naphthalimide compound | 大连理工大学 | 2020-09-29 | — | — | CN | disclosed |